Exact Mass: 625.1557

Exact Mass Matches: 625.1557

Found 16 metabolites which its exact mass value is equals to given mass value 625.1557, within given mass tolerance error 4.0E-5 dalton. Try search metabolite list with more accurate mass tolerance error 8.0E-6 dalton.

Pinotin A

7-(3,4-dihydroxyphenyl)-11-hydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2lambda4,8-dioxatricyclo[7.3.1.0^{5,13}]trideca-1(13),2,4,6,9,11-hexaen-2-ylium

C31H29O14+ (625.1557)


Isolated from red wine including Pinotage (CCD). Pinotin A is found in grape wine and common grape. Pinotin A is found in common grape. Pinotin A is isolated from red wine including Pinotage (CCD

   

Petunidin 3-(6'-p-coumaroyl-glucoside)

2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxy-3-{[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}-1lambda4-chromen-1-ylium

C31H29O14 (625.1557)


Petunidin 3-(6-p-coumaroyl-glucoside) is a member of the class of compounds known as anthocyanidin 3-o-6-p-coumaroyl glycosides. Anthocyanidin 3-o-6-p-coumaroyl glycosides are anthocyanidin 3-O-glycosides where the carbohydrate moiety is esterified at the C6 position with a p-coumaric acid. P-coumaric acid is an organic derivative of cinnamic acid, that carries a hydroxyl group at the 4-position of the benzene ring. Petunidin 3-(6-p-coumaroyl-glucoside) is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Petunidin 3-(6-p-coumaroyl-glucoside) can be found in a number of food items such as black elderberry, redcurrant, highbush blueberry, and black chokeberry, which makes petunidin 3-(6-p-coumaroyl-glucoside) a potential biomarker for the consumption of these food products.

   

Peonidin 3-(6'-caffeoyl-glucoside)

3-{[(2S,3R,4S,5S,6R)-6-({[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-1λ⁴-chromen-1-ylium

C31H29O14+ (625.1557)


Peonidin 3-(6-caffeoyl-glucoside) is a member of the class of compounds known as anthocyanidin 3-o-6-p-coumaroyl glycosides. Anthocyanidin 3-o-6-p-coumaroyl glycosides are anthocyanidin 3-O-glycosides where the carbohydrate moiety is esterified at the C6 position with a p-coumaric acid. P-coumaric acid is an organic derivative of cinnamic acid, that carries a hydroxyl group at the 4-position of the benzene ring. Peonidin 3-(6-caffeoyl-glucoside) is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Peonidin 3-(6-caffeoyl-glucoside) can be found in common grape, which makes peonidin 3-(6-caffeoyl-glucoside) a potential biomarker for the consumption of this food product.

   

Peonidin 3-(6-caffeylgucoside)

Peonidin 3-(6-caffeylgucoside)

C31H29O14 (625.1557)


   

Petunidin 3-(6-p-coumarylglucoside)

2- (3,4-Dihydroxy-5-methoxyphenyl) -3- [ [ 6-O- [ 3- (4-hydroxyphenyl) acryloyl ] -beta-D-glucopyranosyl ] oxy ] -5,7-dihydroxy-1-benzopyrylium

C31H29O14 (625.1557)


   

Malvidin 3-glucoside-4-vinylcatechol

3,5,7,4-Tetrahydroxy-3,5-dimethoxyflavylium 3-glucoside-4-vinylcatechol

C31H29O14 (625.1557)


   

Pinotin A

7-(3,4-dihydroxyphenyl)-11-hydroxy-3-(4-hydroxy-3,5-dimethoxyphenyl)-4-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2$l^{4},8-dioxatricyclo[7.3.1.0^{5,13}]trideca-1(13),2,4,6,9,11-hexaen-2-ylium

C31H29O14+ (625.1557)


   

Malvidin 3-glucoside-4-vinylcatechol

Malvidin 3-glucoside-4-vinylcatechol

C31H29O14+ (625.1557)


   

Petunidin 3-(6-p-coumaroyl-glucoside)

Petunidin 3-(6-p-coumaroyl-glucoside)

C31H29O14+ (625.1557)


   

2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxychromenium-3-yl 6-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside

2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxychromenium-3-yl 6-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside

C31H29O14+ (625.1557)


   

Peonidin 3-(6-caffeylgucoside)

Peonidin 3-(6-caffeylgucoside)

C31H29O14+ (625.1557)


   

2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxychromenium-3-yl 6-O-[(2Z)-3-(4-hydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside

2-(3,4-dihydroxy-5-methoxyphenyl)-5,7-dihydroxychromenium-3-yl 6-O-[(2Z)-3-(4-hydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside

C31H29O14+ (625.1557)


   

petunidin 3-O-(6-O-(Z)-4-coumaroyl-beta-D-glucoside)

petunidin 3-O-(6-O-(Z)-4-coumaroyl-beta-D-glucoside)

C31H29O14 (625.1557)


An anthocyanin cation that is petunidin substituted at position 3 by a 6-O-(cis-4 coumaryl)-beta-D-glucosyl residue.

   

petunidin 3-O-(6-O-(E)-4-coumaroyl-beta-D-glucoside)

petunidin 3-O-(6-O-(E)-4-coumaroyl-beta-D-glucoside)

C31H29O14 (625.1557)


An anthocyanin cation that is petunidin substituted at position 3 by a 6-O-(trans-4 coumaryl)-beta-D-glucosyl residue

   

Peonidin 3-(6'-caffeylgucoside)

Peonidin 3-(6'-caffeylgucoside)

C31H29O14 (625.1557)


   

Petunidin-3-O-(6-O-p-coumaroyl)-glucoside

Petunidin-3-O-(6-O-p-coumaroyl)-glucoside

C31H29O14 (625.1557)